SCHEMBL3639641

SCHEMBL3639641

CCOC(=O)C1C(C)=CC=CC12CCCC2

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.39
POLB P06746 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
HPGD P15428 2/20 0.33
KDM4E B2RXH2 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TLR4 O00206 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.31
TSHR P16473 3/20 0.31
TAS1R3 Q7RTX0 1/20 0.31
TAS1R1 Q7RTX1 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL19433847 0.80
SCHEMBL2132797 0.78 ALDH1A1 (0.36) ALDH1A1POLBL3MBTL1MEN1KMT2A
SCHEMBL3636786 0.75
SCHEMBL1686188 0.73 ALDH1A1 (0.33) ALDH1A1POLBL3MBTL1MEN1KMT2A
SCHEMBL3643580 0.70 ALDH1A1 (0.40) ALDH1A1POLBL3MBTL1MEN1KMT2A
SCHEMBL3641246 0.70 ALDH1A1 (0.43) ALDH1A1POLBL3MBTL1MEN1KMT2A
SCHEMBL3643802 0.69 ALDH1A1 (0.40) ALDH1A1POLBL3MBTL1MEN1KMT2A
SCHEMBL3646454 0.67 ALDH1A1 (0.40) ALDH1A1MEN1KMT2AHPGDKDM4E
SCHEMBL11526857 0.67 LMNA (0.33) ALDH1A1POLBL3MBTL1MEN1KMT2A
SCHEMBL3637290 0.67 ALDH1A1 (0.38) ALDH1A1POLBL3MBTL1MEN1KMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2167621-B1 ORGANIC COMPOUNDS AS ODORANTS GIVAUDAN SA (CH) 2017-10-11 EP claimed
US-9012391-B2 Organic compounds GIVAUDAN SA (CH) 2015-04-21 US claimed
US-20100292128-A1 Organic Compounds GIVAUDAN SA (CH) 2010-11-18 US claimed
EP-2167621-A1 ORGANIC COMPOUNDS Givaudan SA (CH) 2010-03-31 EP claimed
WO-2008151455-A1 ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2008-12-18 WO claimed
EP-2167621-B1 ORGANIC COMPOUNDS AS ODORANTS GIVAUDAN SA (CH) 2017-10-11 EP disclosed
US-9012391-B2 Organic compounds GIVAUDAN SA (CH) 2015-04-21 US disclosed
US-20100292128-A1 Organic Compounds GIVAUDAN SA (CH) 2010-11-18 US disclosed
EP-2167621-A1 ORGANIC COMPOUNDS Givaudan SA (CH) 2010-03-31 EP disclosed
WO-2008151455-A1 ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2008-12-18 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100292128-A1 Organic Compounds TRPA1, FASN, OR10J3 ALDH1A1 99/4885POLB 2465/4885L3MBTL1 3469/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.